SCHEMBL8145690

SCHEMBL8145690

Nc1ccc(F)c(Oc2cc(Oc3c(F)ccc(N)c3F)c(C(F)(F)F)cc2C(F)(F)F)c1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
MPL P40238 2/20 0.34
AR P10275 2/20 0.33
KIF11 P52732 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
THRB P10828 1/20 0.33
G6PD P11413 1/20 0.33
ALOX15 P16050 1/20 0.33
CASP1 P29466 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HTR2A P28223 2/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8152761 0.97 KDM4E (0.34) KDM4EMAPTCRHBPCRHR2MPL
SCHEMBL8151821 0.88 KIF11 (0.35) KDM4EMAPTCRHBPCRHR2MPL
SCHEMBL8137165 0.85 MPL (0.35) KDM4EMAPTCRHBPCRHR2MPL
SCHEMBL8147207 0.85 AR (0.41) KDM4EMAPTCRHBPCRHR2AR
SCHEMBL8147224 0.84 KDM4E (0.36) KDM4EMAPTCRHBPCRHR2MEN1
SCHEMBL8147212 0.83 AR (0.34) KDM4EMAPTCRHBPCRHR2MPL
SCHEMBL8145642 0.83 AR (0.34) KDM4EMAPTCRHBPCRHR2AR
SCHEMBL8146669 0.83 KDM4E (0.35) KDM4EMAPTCRHBPCRHR2MEN1
SCHEMBL8146743 0.81 KDM4E (0.34) KDM4EMAPTCRHBPCRHR2KIF11
SCHEMBL8143676 0.81 KDM4E (0.34) KDM4EMAPTCRHBPCRHR2MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6103860-A LOW DIELECTRIC CONSTANT, EXCELLENT TRANSPARENCY, LOW HYGROSCOPICITY AND EXCELLENT PROCESSABILITY; SUBSTRATE FOR AN OPTICAL DISK, A PICK-UP LENS, A PLASTIC SUBSTRATE FOR A LIQUID CELL AND A PRISM MITSUI CHEMICALS, INC. (JP) 2000-08-15 US disclosed
US-5990261-A Organic optical component MITSUI CHEMICALS, INC. (JP) 1999-11-23 US disclosed
EP-0826717-A1 An organic optical component MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1998-03-04 EP disclosed